[4-[ethanoyl-[2-oxidanyl-1-phenoxy-3-(propan-2-ylamino)propyl]amino]-4-oxidanylidene-butyl] nitrate

Systemtic Name: [4-[ethanoyl-[2-oxidanyl-1-phenoxy-3-(propan-2-ylamino)propyl]amino]-4-oxidanylidene-butyl] nitrate Openeye Name: [4-[acetyl-[2-hydroxy-3-(isopropylamino)-1-phenoxy-propyl]amino]-4-oxo-butyl] nitrate CAS Name: nitric acid [4-[acetyl-[2-hydroxy-1-phenoxy-3-(propan-2-ylamino)propyl]amino]-4-oxobutyl] ester IUPAC Name: [4-[acetyl-[2-hydroxy-1-phenoxy-3-(propan-2-ylamino)propyl]amino]-4-oxobutyl] nitrate Traditional Name: nitric acid [4-[acetyl-[2-hydroxy-3-(isopropylamino)-1-phenoxy-propyl]amino]-4-keto-butyl] ester Formula: C18H27N3O7 MolecularWeight: 397.42288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(C(N(C(=O)C)C(=O)CCCO[N+](=O)[O-])OC1=CC=CC=C1)O

Isomeric SMILES

CC(C)NCC(C(N(C(=O)C)C(=O)CCCO[N+](=O)[O-])OC1=CC=CC=C1)O

InChI

InChI=1S/C18H27N3O7/c1-13(2)19-12-16(23)18(28-15-8-5-4-6-9-15)20(14(3)22)17(24)10-7-11-27-21(25)26/h4-6,8-9,13,16,18-19,23H,7,10-12H2,1-3H3